A PARAMETRIZATION OF THE TFDW DENSITY FOR ATOMS AND DIATOMIC QUASI-MOLECULES

被引：6

作者：

SCHEIDEMANN, A ^{[1
]}

DREIZLER, RM ^{[1
]}

机构：

[1] UNIV FRANKFURT MAIN, INST THEORET PHYS, D-6000 FRANKFURT 11, FED REP GER

来源：

ZEITSCHRIFT FUR PHYSIK D-ATOMS MOLECULES AND CLUSTERS | 1986年 / 2卷 / 01期

关键词：

D O I：

10.1007/BF01437241

中图分类号：

O64 [物理化学（理论化学）、化学物理学]; O56 [分子物理学、原子物理学];

学科分类号：

070203 ; 070304 ; 081704 ; 1406 ;

摘要：

引用

页码：43 / 47

页数：5

共 20 条

[1]

Arthurs A M, 1980, COMPLEMENTARY VARIAT

[2]

BALAZS NL, 1967, PHYS REV, V156, P156

[3] COMPLEMENTARY VARIATIONAL PRINCIPLE FOR DENSITY-FUNCTIONAL THEORIES [J].

BERK, A .

PHYSICAL REVIEW A, 1983, 27 (01) :1-11

[4] LOWER-BOUND ENERGY FUNCTIONALS AND THEIR APPLICATION TO DIATOMIC SYSTEMS [J].

BERK, A .

PHYSICAL REVIEW A, 1983, 28 (04) :1908-1923

[5]

DREIZLER RM, 1985, ASI SERIES B, V123

[6] MOLECULAR-ORBITAL CORRELATION DIAGRAMS FOR HE-2, HE-2(+), N-2, N-2(+), CO, AND CO+ [J].

ERMLER, WC ;

MULLIKEN, RS ;

WAHL, AC .

JOURNAL OF CHEMICAL PHYSICS, 1977, 66 (07) :3031-3038

[7]

GOODISMAN J, 1973, DIATOMIC INTERACTION, V1

[8] THOMAS-FERMI APPROACH TO DIATOMIC SYSTEMS .1. SOLUTION OF THE THOMAS-FERMI AND THOMAS-FERMI-DIRAC-WEIZSACKER EQUATIONS [J].

GROSS, EKU ;

DREIZLER, RM .

PHYSICAL REVIEW A, 1979, 20 (05) :1798-1807

[9] INHOMOGENEOUS ELECTRON-GAS [J].

RAJAGOPAL, AK ;

CALLAWAY, J .

PHYSICAL REVIEW B, 1973, 7 (05) :1912-1919

[10] Calculation of the electron distribution in a diatomic molecule by the method of Thomas and Fermi. [J].

Hund, F. .

ZEITSCHRIFT FUR PHYSIK, 1932, 77 (1-2) :12-25

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